Geometry & MOs

Info

ID:	24854
PubChem CID:	613914
Reduced:	NSO2C11H13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	223.0667
ΔH_f, kcal/mol:	-69.67
Dipole, Da:	2.83
IP(EA), eV:	-9.1(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5,5-dimethyl-4H-1,3-thiazol-2-yl)benzene-1,3-diol

Drug info:

PubChemData

Smile

CC1(CN=C(S1)C2=C(C=C(C=C2)O)O)C

DOS

IR

Vibrations